%chk=000102225.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102225

0 1
 O    4.942700       1.077000     -0.4341000    
 O   -5.849600      8.1500001E-02  0.3096000    
 C    1.969000     -0.7090000     -0.2057000    
 C    2.653500      0.6042000      0.2405000    
 C   0.4993000     -0.7373000      0.2228000    
 C  -0.2246000      0.4484000     -0.5013000    
 C    1.994900       1.763000     -0.5025000    
 C    2.929800      -1.799300      0.2605000    
 C   0.4776000       1.803300     -0.2385000    
 C    4.075000      0.2576000     -0.1630000    
 C    4.300900      -1.244500     -0.1547000    
 C    2.684100      0.8688000       1.758100    
 C   -1.722400      0.3982000     -0.2214000    
 C  -0.2035000      -2.038900     -7.7900000E-02
 C   -2.341100     -0.8717000     -0.1472000    
 C   -1.531500      -2.092400     -0.2551000    
 C   -2.521600       1.544800     -0.1181000    
 C   -3.727500     -0.9705000      2.5000000E-02
 C   -3.901600       1.435200      6.6900000E-02
 C   -4.503400      0.1816000      0.1361000    
 H    1.982500     -0.7579000      -1.308800    
 H   0.4351000     -0.6050000       1.310700    
 H  -0.1402000      0.2783000      -1.587400    
 H    2.170400       1.666400      -1.582100    
 H    2.445400       2.719200     -0.2098000    
 H    2.876700      -1.950300       1.344100    
 H    2.740600      -2.764400     -0.2193000    
 H   0.2906000       2.124600      0.7934000    
 H   4.8300002E-02   2.578600     -0.8848000    
 H    4.566200      -1.567300      -1.165600    
 H    5.079500      -1.520500      0.5596000    
 H    3.198700      7.6200001E-02   2.311500    
 H    3.231200       1.795800       1.969200    
 H    1.686300      0.9765000       2.191100    
 H   0.3656000      -2.962500     -0.1021000    
 H   -2.029800      -3.038600     -0.4350000    
 H   -2.093300       2.539900     -0.1869000    
 H   -4.201900      -1.948200      7.9300001E-02
 H   -4.503600       2.336600      0.1473000    
 H   -6.095900     -0.8591000      0.3343000    


%chk=000102225-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102225

0 1
O 5.012465 1.156997 -0.479842
O -5.945218 0.179423 0.309080
C 1.987687 -0.737027 -0.199380
C 2.670441 0.608812 0.195751
C 0.504106 -0.768008 0.212765
C -0.224790 0.415802 -0.506938
C 1.984120 1.771486 -0.550874
C 2.979136 -1.826596 0.289076
C 0.458981 1.785507 -0.250252
C 4.138027 0.312906 -0.170763
C 4.361495 -1.215732 -0.083806
C 2.692975 0.876050 1.735810
C -1.727073 0.384792 -0.204275
C -0.202002 -2.075337 -0.109256
C -2.372101 -0.893306 -0.171594
C -1.553934 -2.114077 -0.287055
C -2.522134 1.541905 -0.046105
C -3.777632 -0.977168 -0.009624
C -3.921028 1.463579 0.133503
C -4.546791 0.198357 0.142278
H 2.005858 -0.776185 -1.313940
H 0.435005 -0.613849 1.314689
H -0.119263 0.199493 -1.597680
H 2.144320 1.646899 -1.640647
H 2.438125 2.739760 -0.269882
H 2.893333 -1.984941 1.380411
H 2.815642 -2.802875 -0.198881
H 0.279660 2.097078 0.797800
H -0.014752 2.556319 -0.888167
H 4.705211 -1.563199 -1.077766
H 5.175486 -1.447872 0.626227
H 3.157490 0.048597 2.301398
H 3.277787 1.791711 1.936051
H 1.676987 1.025724 2.138319
H 0.389713 -2.999112 -0.138773
H -2.067546 -3.066986 -0.469222
H -2.055756 2.531730 -0.062977
H -4.261154 -1.963985 0.010732
H -4.533818 2.360619 0.260479
H -6.286660 -0.748990 0.302030


